@<TRIPOS>MOLECULE
REAL300019630655
  42   44    0    0    0
SMALL
NO_CHARGES
@<TRIPOS>ATOM
   1 C1             6.8268     2.3893    -2.5290 C.3     
   2 C2             5.8002     3.4827    -2.2266 C.3     
   3 C3             5.7310     3.7135    -0.7157 C.3     
   4 C4             4.6352     4.7013    -0.4081 C.2     
   5 C5             3.2946     4.4117    -0.2483 C.2     
   6 C6             2.6694     3.0806    -0.3461 C.2     
   7 O7             3.2658     2.0980     0.0509 O.2     
   8 N8             1.4366     2.9525    -0.8757 N.am    
   9 C9             0.6794     4.1444    -1.2657 C.3     
  10 C10            0.8799     1.6806    -1.0529 C.2     
  11 N11           -0.3137     1.4039    -1.5579 N.2     
  12 N12           -0.4512     0.1219    -1.5528 N.pl3   
  13 N13            0.6130    -0.4123    -1.0631 N.2     
  14 N14            1.4450     0.5212    -0.7486 N.2     
  15 C15            2.6333     5.6316     0.0207 C.2     
  16 N16            3.5265     6.5826     0.0299 N.2     
  17 N17            4.7827     6.0279    -0.2390 N.pl3   
  18 C18            5.9903     6.7347    -0.3191 C.ar    
  19 C19            7.1297     6.2375     0.2994 C.ar    
  20 C20            8.3192     6.9344     0.2154 C.ar    
  21 C21            8.3739     8.1307    -0.4760 C.ar    
  22 C22            9.6722     8.8912    -0.5612 C.3     
  23 C23            7.2398     8.6308    -1.0889 C.ar    
  24 C24            6.0484     7.9364    -1.0122 C.ar    
  25 H25            6.8761     2.2249    -3.6054 H       
  26 H26            7.8059     2.6990    -2.1635 H       
  27 H27            6.5297     1.4650    -2.0335 H       
  28 H28            4.8212     3.1730    -2.5921 H       
  29 H29            6.0973     4.4070    -2.7221 H       
  30 H30            6.6846     4.1076    -0.3643 H       
  31 H31            5.5207     2.7694    -0.2132 H       
  32 H32            0.1587     4.5449    -0.3959 H       
  33 H33            1.3633     4.8970    -1.6581 H       
  34 H34           -0.0472     3.8782    -2.0333 H       
  35 H35            1.5741     5.7545     0.1920 H       
  36 H36            7.0867     5.3051     0.8427 H       
  37 H37            9.2065     6.5467     0.6937 H       
  38 H38            9.7442     9.5824     0.2785 H       
  39 H39           10.5065     8.1907    -0.5277 H       
  40 H40            9.7048     9.4507    -1.4962 H       
  41 H41            7.2855     9.5656    -1.6279 H       
  42 H42            5.1627     8.3278    -1.4905 H       
@<TRIPOS>BOND
   1    1    2 1
   2    1   25 1
   3    1   26 1
   4    1   27 1
   5    2    3 1
   6    2   28 1
   7    2   29 1
   8    3    4 1
   9    3   30 1
  10    3   31 1
  11    4   17 1
  12    4    5 2
  13    5    6 1
  14    5   15 1
  15    6    7 2
  16    6    8 am
  17    8    9 1
  18    8   10 1
  19    9   32 1
  20    9   33 1
  21    9   34 1
  22   10   14 1
  23   10   11 2
  24   11   12 1
  25   12   13 1
  26   13   14 2
  27   15   16 2
  28   15   35 1
  29   16   17 1
  30   17   18 1
  31   18   24 ar
  32   18   19 ar
  33   19   20 ar
  34   19   36 1
  35   20   21 ar
  36   20   37 1
  37   21   22 1
  38   21   23 ar
  39   22   38 1
  40   22   39 1
  41   22   40 1
  42   23   24 ar
  43   23   41 1
  44   24   42 1